| SpectraBase Compound ID | 7qrn5D9I5r3 |
|---|---|
| InChI | InChI=1S/C18H27NO6/c1-4-11-7-10(2)18(3,23)17(22)24-9-12-13(20)8-19-6-5-14(15(12)19)25-16(11)21/h4,10,12-15,20,23H,5-9H2,1-3H3/b11-4+/t10-,12+,13-,14-,15?,18?/m1/s1 |
| InChIKey | YEXVXKIMPBHRQR-PYAURLAHSA-N |
| Mol Weight | 353.42 g/mol |
| Molecular Formula | C18H27NO6 |
| Exact Mass | 353.183838 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | FoQBJAQ0wc5 |
|---|---|
| Name | Neorosmarinine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H27NO6 |
| InChI | InChI=1S/C18H27NO6/c1-4-11-7-10(2)18(3,23)17(22)24-9-12-13(20)8-19-6-5-14(15(12)19)25-16(11)21/h4,10,12-15,20,23H,5-9H2,1-3H3/b11-4+/t10-,12+,13-,14-,15?,18?/m1/s1 |
| InChIKey | YEXVXKIMPBHRQR-PYAURLAHSA-N |
| Molecular Weight | 353.415 g/mol |
| SMILES | OC1(C(OC[C@@]2(C3N(C[C@]2(O)[H])CC[C@]3(OC(\C(C[C@]1(C)[H])=C/C)=O)[H])[H])=O)C |
| SPLASH | splash10-000x-9500000000-e0f1b759d61a2b513743 |
| Source of Spectrum | X2-54-498-3 |
| Wiley ID | 1604009 |